Chemical ID: 6470450

Cc1ccccc1C(=O)NCCN2CCCC2
Chemical ID:
6470450
Name [?]:
2-methyl-N-(2-pyrrolidin-1-ylethyl)benzamide
SMILES [?]:
Cc1ccccc1C(=O)NCCN2CCCC2
InChi [?]:
InChI=1/C14H20N2O/c1-12-6-2-3-7-13(12)14(17)15-8-11-16-9-4-5-10-16/h2-3,6-7H,4-5,8-11H2,1H3,(H,15,17)
InChi Info:
AuxInfo=1/1/N:1,4,5,15,16,3,6,11,14,17,12,2,7,8,10,13,9/E:(4,5)(9,10)/rA:17nCCCCCCCCONCCNCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;d8;s8;s10;s11;s12;s13;s14;s15;s13s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H20N2O
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.97894
Area:434.819
Solvation:-1.89153
Coulombic:-28.1483
Bond Count [?]
All:18
Single:14
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:232.321
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.22
LogP (Chemaxon):1.72

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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